Chem
J-GLOBAL ID：200907001058167351   Nikkaji number：J2.584.597H

(2R)-2β-[2-[3-(3,5-Dimethylphenyl)-6-(1-methyl-1H-pyrazole-4-yl)-7-chloroquinoline-4-yloxy]ethyl]piperidine-1-carboxylic acid tert-butyl ester

(2R)-2β-[2-[3-(3,5-ジメチルフェニル)-6-(1-メチル-1H-ピラゾール-4-イル)-7-クロロキノリン-4-イルオキシ]エチル]ピペリジン-1-カルボン酸tert-ブチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C33H39ClN4O3
Molecular formula furigana： C33-H39-CL-N4-O3
Molecular weight： 575.150
InChI： InChI=1S/C33H39ClN4O3/c1-21-13-22(2)15-23(14-21)28-19-35-30-17-29(34)26(24-18-36-37(6)20-24)16-27(30)31(28)40-12-10-25-9-7-8-11-38(25)32(39)41-33(3,4)5/h13-20,25H,7-12H2,1-6H3/t25-/m1/s1
InChI key： JSBZANVYGQLZBN-RUZDIDTESA-N
SMILES： Cc1cc(C)cc(c1)c1cnc2cc(Cl)c(cc2c1OCC[C@H]1CCCCN1C(=O)OC(C)(C)C)c1cnn(C)c1
Systematic name  (3)：
  • (2R)-2β-[2-[3-(3,5-ジメチルフェニル)-6-(1-メチル-1H-ピラゾール-4-イル)-7-クロロキノリン-4-イルオキシ]エチル]ピペリジン-1-カルボン酸tert-ブチル
  • tert-ブチル (2R)-2-(2-{[7-クロロ-3-(3,5-ジメチルフェニル)-6-(1-メチル-1H-ピラゾール-4-イル)キノリン-4-イル]オキシ}エチル)ピペリジン-1-カルボキシラート
  • tert-butyl (2R)-2-(2-{[7-chloro-3-(3,5-dimethylphenyl)-6-(1-methyl-1H-pyrazol-4-yl)quinolin-4-yl]oxy}ethyl)piperidine-1-carboxylate
Other name (1)：
  • (2R)-2β-[2-[3-(3,5-Dimethylphenyl)-6-(1-methyl-1H-pyrazole-4-yl)-7-chloroquinoline-4-yloxy]ethyl]piperidine-1-carboxylic acid tert-butyl ester
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